{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9897256 -6.0227084 -0.8121122 ] [ 1.8353352 -2.3381537 -1.9783727 ] [ 7.9750627 -6.283672 10.2403517 ] [ -0.0925868 4.3417892 -13.027734 ] [ -3.7280855 10.3027449 5.5778672 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.596598321327253e-09 -9.649442592375775e-09 -1.301147180306454e-09 ] [ 2.940531148771293e-09 -3.746135193977017e-09 -3.169702487168972e-09 ] [ 1.277745900735413e-08 -1.006755237117558e-08 1.640685208250954e-08 ] [ -1.483404063546854e-10 6.956313148681936e-09 -2.087273083680127e-08 ] [ -5.973051428443479e-09 1.650681700884644e-08 8.936728421767157e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2857298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.468672709425861e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4617538 -0.4742366 1.6689985 ] [ 2.4339023 0.1936709 -0.3992629 ] [ 1.3479129 1.2463806 3.3183882 ] [ 1.4183455 2.0637252 0.7445225 ] [ 2.2251744 3.3483416 2.6248122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4617538e-10 -4.742366e-11 1.6689985e-10 ] [ 2.4339023e-10 1.936709e-11 -3.992629e-11 ] [ 1.3479129e-10 1.2463806e-10 3.3183882e-10 ] [ 1.4183455e-10 2.0637252e-10 7.445225e-11 ] [ 2.2251744e-10 3.3483416e-10 2.6248122e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -1.18e-05 3e-06 ] [ -5.2e-06 -8.5e-06 -9e-06 ] [ 2e-07 -7e-07 4.8e-06 ] [ 9.2e-06 1.09e-05 -7.1e-06 ] [ -5.5e-06 1.01e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-15 -1.890568412544e-14 4.8065298624e-15 ] [ -8.33131842816e-15 -1.36185012768e-14 -1.44195895872e-14 ] [ 3.2043532416e-16 -1.12152363456e-15 7.69044777984e-15 ] [ 1.474002491136e-14 1.746372516672e-14 -1.137545400768e-14 ] [ -8.8119714144e-15 1.618198387008e-14 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.036401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409097014317374e-18 } }